Structure Information
Structure

Compound Identification

SMILES

CN1C=NC2=C1C(=O)N(C)C(=O)N2C.CC(C)CC1(CC=C)C(=O)NC(=O)NC1=O.CN(C)C1=C(C)N(C)N(C1=O)C1=CC=CC=C1

InChIKey

InChIKey=YTEZOIYKTFWJPC-UHFFFAOYSA-N

Formula

C32H43N9O6

Mass

649.753

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Purines and purine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Xanthines

Alternative Parents

Molecular Framework

Not available

Substituents

Xanthine - Phenylpyrazole - 6-oxopurine - Purinone - Barbiturate - Alkaloid or derivatives - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Pyrimidone - Ureide - N-acyl urea - 1,3-diazinane - Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Pyrimidine - N-substituted imidazole - Azole - Dicarboximide - Imidazole - Heteroaromatic compound - Vinylogous amide - Pyrazole - Carbonic acid derivative - Lactam - Urea - Tertiary amine - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as xanthines. These are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety.

External Descriptors

Not available

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